nitro-[1-[2-oxidanylidene-2-[(4-sulfamoylphenyl)amino]ethyl]-1,2,4-triazol-4-ium-4-yl]azanide

Systemtic Name: nitro-[1-[2-oxidanylidene-2-[(4-sulfamoylphenyl)amino]ethyl]-1,2,4-triazol-4-ium-4-yl]azanide Openeye Name: nitro-[1-[2-oxo-2-(4-sulfamoylanilino)ethyl]-1,2,4-triazol-4-ium-4-yl]azanide CAS Name: nitro-[1-[2-oxo-2-(4-sulfamoylanilino)ethyl]-1,2,4-triazol-4-ium-4-yl]azanide IUPAC Name: nitro-[1-[2-oxo-2-(4-sulfamoylanilino)ethyl]-1,2,4-triazol-4-ium-4-yl]azanide Traditional Name: [1-[2-keto-2-(4-sulfamoylanilino)ethyl]-1,2,4-triazol-4-ium-4-yl]-nitro-azanide Formula: C10H11N7O5S MolecularWeight: 341.30324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)CN2C=[N+](C=N2)[N-][N+](=O)[O-])S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1NC(=O)CN2C=[N+](C=N2)[N-][N+](=O)[O-])S(=O)(=O)N

InChI

InChI=1S/C10H11N7O5S/c11-23(21,22)9-3-1-8(2-4-9)13-10(18)5-15-7-16(6-12-15)14-17(19)20/h1-4,6-7H,5H2,(H,13,18)(H2,11,21,22)